0 B5R0.5 CC(=O)[C@H](C)N D76571 [0,0,0,0,0,0|1,1,1]=3 1 B5R0.5 CC(=S)N(C)C 76921 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.5 C[C@H](N)C(N)=O 25148 [0,0,0,0,0,0|2,1,1]=4 3 B5R0.5 C[C@H](O)C(=N)N 71516 [0,0,0,0,0,0|2,1,1]=4 4 B5R0.5 C[C@H](O)[C@H](C)O C91323 [0,0,0,0,0,0|0,2,0]=2 5 B4R0.1 C#C[C@H](C)N AB1311 [1,0,0,0,0,0|1,0,2]=4 6 B4R0.1 C#C[C@H](C)N F31055 [1,0,0,0,0,0|1,0,2]=4 7 B4R0.1 C=C[C@H](C)N 81150 [1,0,0,0,0,0|1,0,2]=4 8 B4R0.1 C=C[C@H](C)N C77628 [1,0,0,0,0,0|1,0,2]=4 9 B4R0.1 C=C[C@H](C)N N11410 [1,0,0,0,0,0|1,0,2]=4 10 B4R0.1 CC(C)CBr P19652 [1,0,0,0,0,0|2,0,0]=3 11 B4R0.1 CC[C@H](C)N 74047 [1,0,0,0,0,0|1,0,0]=2 12 B4R0.1 C[C@H](Br)CN F11189 [1,0,0,0,0,0|2,0,0]=3 13 B4R0.1 C[C@H](Br)CO W17591 [1,0,0,0,0,0|1,1,0]=3 14 B4R0.1 C[C@H](Cl)CN Y14715 [1,0,0,0,0,0|2,0,0]=3 15 B4R0.1 C[C@H](N)C#N I11084 [1,0,0,0,0,0|2,0,1]=4 16 B4R0.1 C[C@H](N)CF AC1136 [1,0,0,0,0,0|2,0,0]=3 17 B4R0.1 C[C@H](N)CF AC6177 [1,0,0,0,0,0|2,0,0]=3 18 B4R0.1 C\C=C(\C)Br D93160 [1,0,0,0,0,0|1,0,2]=4 19 B4R0.1 NCC(F)F C16390 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.3 CC(C)C(=O)CCl D94573 [0,1,0,0,0,0|1,1,1]=4 21 B6R0.3 CC(C)[C@@H](C)CO D93394 [0,1,0,0,0,0|1,1,0]=3 22 B6R0.3 CC[C@H](N)[C@@H](C)O N14663 [0,1,0,0,0,0|1,1,0]=3 23 B6R0.3 CNC(=O)[C@H](C)N C78177 [0,1,0,0,0,0|1,1,1]=4 24 B6R0.3 CNC(=O)[C@H](C)N C78349 [0,1,0,0,0,0|1,1,1]=4 25 B6R0.3 CNC(=O)[C@H](C)N FD21069 [0,1,0,0,0,0|1,1,1]=4 26 B6R0.3 O[C@@H](CBr)C(F)F AC5394 [0,1,0,0,0,0|2,1,0]=4 27 B6R0.7 CC(=O)C(C)(C)N 71804 [0,1,0,0,0,0|1,1,1]=4 28 B6R0.7 CC(C)(S)C(=O)O F17054 [0,1,0,0,0,0|1,1,1]=4 29 B6R0.7 CC(C)C(C)(C)Cl H10395 [0,1,0,0,0,0|2,0,0]=3 30 B6R0.7 C[C@H](N)C(C)(C)C F16897 [0,1,0,0,0,0|2,0,0]=3 31 B6R0.7 C[C@H](N)C(C)(C)C N11972 [0,1,0,0,0,0|2,0,0]=3 32 B6R0.7 C[C@H](N)C(C)(C)O 86272 [0,1,0,0,0,0|1,1,0]=3 33 B6R0.7 C[C@H](N)C(C)(F)F 91519 [0,1,0,0,0,0|2,0,0]=3 34 B6R0.7 C[C@H](N)C(F)(F)F N12498 [0,1,0,0,0,0|3,0,0]=4 35 B6R0.7 C[C@H](N)C(F)(F)F W17986 [0,1,0,0,0,0|3,0,0]=4 36 B6R0.7 C[C@H](O)C(C)(C)C D93306 [0,1,0,0,0,0|1,1,0]=3 37 B6R0.7 C[C@H](O)C(C)(C)O D80869 [0,1,0,0,0,0|0,2,0]=3 38 B6R0.7 C[C@H](O)C(F)(F)F W16425 [0,1,0,0,0,0|2,1,0]=4 39 B6R1.4 CC1NCC1F P20228 [0,0,0,1,0,0|2,0,0]=3 40 B6R1.4 CC1OCC1O P16543 [0,0,0,1,0,0|0,2,0]=3 41 B6R1.4 C[C@@H]1OCC1=O P16003 [0,0,0,1,0,0|0,2,1]=4 42 B6R1.4 C[C@H]1CCC1=O W18267 [0,0,0,1,0,0|1,1,1]=4 43 B6R1.4 C[C@H]1NC[C@@H]1F P20392 [0,0,0,1,0,0|2,0,0]=3 44 B6R1.4 C[C@H]1NC[C@@H]1O D79131 [0,0,0,1,0,0|1,1,0]=3 45 B6R1.4 C[C@H]1NC[C@@H]1O P18430 [0,0,0,1,0,0|1,1,0]=3 46 B6R1.4 NC1CCC1F P20418 [0,0,0,1,0,0|2,0,0]=3 47 B6R1.4 NC1CCC1O 94999 [0,0,0,1,0,0|1,1,0]=3 48 B6R1.4 N[C@@H]1CC[C@@H]1O P18786 [0,0,0,1,0,0|1,1,0]=3 49 B6R1.4 O=C1CC[C@@H]1Br P18435 [0,0,0,1,0,0|1,1,1]=4 50 B6R1.4 OC1CCC1O D79179 [0,0,0,1,0,0|0,2,0]=3 51 B6R1.4 O[C@H]1CC[C@@H]1O P21043 [0,0,0,1,0,0|0,2,0]=3 52 B6R1.9 CC1(C)C[C@@H]1N 69330 [0,0,0,1,0,0|2,0,0]=3 53 B6R1.9 FC1(F)C[C@@H]1Br P15979 [0,0,0,1,0,0|3,0,0]=4 54 B6R1.11 C[C@H](N)C1CC1 N10509 [0,0,0,1,0,0|2,0,0]=3 55 B6R1.11 C[C@H](N)C1CC1 W12229 [0,0,0,1,0,0|2,0,0]=3 56 B6R1.11 C[C@H](O)C1CC1 C77522 [0,0,0,1,0,0|1,1,0]=3 57 B6R1.11 C[C@H](O)C1CC1 C77523 [0,0,0,1,0,0|1,1,0]=3 58 B6R0.2 CC(Br)CC(C)Br T70499 [0,0,0,0,0,1|2,0,0]=3 59 B6R0.2 C[C@H](N)CN(C)C 76720 [0,0,0,0,0,1|3,0,0]=4 60 B6R0.2 C[C@H](O)CN(C)C A11394 [0,0,0,0,0,1|2,1,0]=4 61 B3R0.1 CCNN D79778 [2,0,0,0,0,0|2,0,0]=4 62 B3R0.1 CCON C13232 [2,0,0,0,0,0|2,0,0]=4 63 B3R0.1 C[Se][Se]C H10908 [2,0,0,0,0,0|2,0,0]=4 64 B3R0.1 ClCCI T71139 [2,0,0,0,0,0|2,0,0]=4 65 B3R0.1 NCCN A12036 [2,0,0,0,0,0|2,0,0]=4 66 B3R0.1 NCCN T72722 [2,0,0,0,0,0|2,0,0]=4 67 B3R0.2 CC(Br)Br D78418 [2,0,0,0,0,0|2,0,0]=4 68 B3R0.2 C[S+](C)C AC2631 [2,0,0,0,0,0|2,0,0]=4 69 B5R0.1 C=CC[C@H](C)O 71459 [1,1,0,0,0,0|0,1,1]=4 70 B5R0.1 C=CC[C@H](C)O A12634 [1,1,0,0,0,0|0,1,1]=4 71 B5R0.1 CCC[C@H](C)N P14575 [1,1,0,0,0,0|1,0,0]=3 72 B5R0.1 CCC[C@H](C)N Y10887 [1,1,0,0,0,0|1,0,0]=3 73 B5R0.1 CN(C)CCO D93012 [1,1,0,0,0,0|2,0,0]=4 74 B5R0.1 CNCC(F)F D86102 [1,1,0,0,0,0|2,0,0]=4 75 B5R0.1 CNC[C@H](C)O AC1157 [1,1,0,0,0,0|0,1,0]=3 76 B5R0.1 CNC[C@H](C)O N12528 [1,1,0,0,0,0|0,1,0]=3 77 B5R0.1 COC[C@H](C)Br 78860 [1,1,0,0,0,0|1,0,0]=3 78 B5R0.1 COC[C@H](C)N 25526 [1,1,0,0,0,0|1,0,0]=3 79 B5R0.1 COC[C@H](C)N D95458 [1,1,0,0,0,0|1,0,0]=3 80 B5R0.1 COC[C@H](C)N W17998 [1,1,0,0,0,0|1,0,0]=3 81 B5R0.1 C[C@H](N)CC#N 12486 [1,1,0,0,0,0|1,0,1]=4 82 B5R0.1 C[C@H](O)CC#N 87623 [1,1,0,0,0,0|0,1,1]=4 83 B5R0.1 C[C@H](O)CCN 83616 [1,1,0,0,0,0|0,1,0]=3 84 B5R0.1 C[C@H](O)CON O10313 [1,1,0,0,0,0|0,2,0]=4 85 B5R0.1 C[S+](C)CCCl 77752 [1,1,0,0,0,0|2,0,0]=4 86 B5R0.1 NCCC(F)F D77085 [1,1,0,0,0,0|2,0,0]=4 87 B5R0.1 OCCC(F)F P18054 [1,1,0,0,0,0|2,0,0]=4 88 B5R0.3 CCC(=O)CN S11993 [1,1,0,0,0,0|0,1,1]=4 89 B5R0.3 CC[C@H](C)CN 88665 [1,1,0,0,0,0|1,0,0]=3 90 B5R0.3 CC[C@H](N)C#N 98383 [1,1,0,0,0,0|1,0,1]=4 91 B5R0.3 CC[PH](=O)CC C77650 [1,1,0,0,0,0|1,1,0]=4 92 B5R0.3 CN[C@@H](C)CO AC8719 [1,1,0,0,0,0|1,1,0]=4 93 B5R0.3 CN[C@@H](C)CO C77593 [1,1,0,0,0,0|1,1,0]=4 94 B5R0.3 CN[C@@H](C)CO D80042 [1,1,0,0,0,0|1,1,0]=4 95 B5R0.3 CN[C@@H](C)CO D80344 [1,1,0,0,0,0|1,1,0]=4 96 B5R0.3 CN[C@@H](C)CO D82586 [1,1,0,0,0,0|1,1,0]=4 97 B5R0.3 CO[C@@H](C)CN 91001 [1,1,0,0,0,0|1,1,0]=4 98 B5R0.3 CO[C@@H](C)CO 91002 [1,1,0,0,0,0|0,2,0]=4 99 B5R0.3 C[C@@H](CN)CCl 72948 [1,1,0,0,0,0|2,0,0]=4 100 B5R0.3 C[C@@H](CO)CBr AB3182 [1,1,0,0,0,0|1,1,0]=4 101 B5R0.3 FCC(I)CF AC4509 [1,1,0,0,0,0|2,0,0]=4 102 B5R0.3 NC[C@H](Br)CBr AC1488 [1,1,0,0,0,0|2,0,0]=4 103 B5R0.3 NC[C@H](F)CO 94841 [1,1,0,0,0,0|1,1,0]=4 104 B5R0.3 NC[C@H](F)CO 94845 [1,1,0,0,0,0|1,1,0]=4 105 B5R0.3 NC[C@H](F)CO 94846 [1,1,0,0,0,0|1,1,0]=4 106 B5R0.3 NC[C@H](O)CCl C10413 [1,1,0,0,0,0|1,1,0]=4 107 B5R0.3 NC[C@H](O)CF 94771 [1,1,0,0,0,0|1,1,0]=4 108 B5R0.3 OC[C@H](O)CF 65949 [1,1,0,0,0,0|0,2,0]=4 109 B5R0.3 OC[C@H](O)CF F14582 [1,1,0,0,0,0|0,2,0]=4 110 B5R0.4 CC(C)(Br)CN 55595 [1,1,0,0,0,0|2,0,0]=4 111 B5R0.4 CC(C)(Cl)CCl H11156 [1,1,0,0,0,0|2,0,0]=4 112 B5R0.4 CC(C)(F)CBr 29918 [1,1,0,0,0,0|2,0,0]=4 113 B5R0.4 CC(C)(F)CO P17817 [1,1,0,0,0,0|1,1,0]=4 114 B5R0.4 CC(C)(O)CBr A11164 [1,1,0,0,0,0|1,1,0]=4 115 B7R0.2 COC(C)CC(C)O 78061 [0,1,0,0,0,1|0,2,0]=4 116 B7R0.9 CC(C)OC(C)(C)C A10887 [0,1,0,0,0,1|2,0,0]=4 117 B7R0.5 CC(C)[C@@H](O)CCN 83602 [0,2,0,0,0,0|1,1,0]=4 118 B7R0.5 CCCC(Br)C(C)Br D81745 [0,2,0,0,0,0|2,0,0]=4 119 B7R0.10 CC[C@@H](C)[C@@H](N)CO 73347 [0,2,0,0,0,0|2,0,0]=4 120 B7R0.10 OC[C@H](O)[C@@H](O)CO T72117 [0,2,0,0,0,0|0,2,0]=4 121 B7R0.10 O[C@@H](CS)[C@@H](O)CS T70362 [0,2,0,0,0,0|0,2,0]=4 122 B7R0.14 CC(C)(C)[C@@H](N)CO 39285 [0,2,0,0,0,0|2,0,0]=4 123 B7R0.14 CC(C)(O)[C@@H](F)CN 89812 [0,2,0,0,0,0|1,1,0]=4 124 B7R0.14 CC(C)(O)[C@@H](F)CN P18828 [0,2,0,0,0,0|1,1,0]=4 125 B7R0.15 CC(C)C(CO)CO 73803 [0,2,0,0,0,0|1,1,0]=4 126 B7R0.15 CC[C@@H](CO)C(C)C C74656 [0,2,0,0,0,0|1,1,0]=4 127 B7R0.15 COC(OC)C(C)C D93459 [0,2,0,0,0,0|1,1,0]=4 128 B7R0.15 COC(OC)[C@H](C)Br AC5914 [0,2,0,0,0,0|1,1,0]=4 129 B7R0.17 CC(C)(N)C(C)(C)O 53161 [0,2,0,0,0,0|1,1,0]=4 130 B5R1.2 C[C@H]1CCN1 98100 [1,0,0,1,0,0|1,0,0]=3 131 B5R1.2 C[C@H]1CCN1 P21034 [1,0,0,1,0,0|1,0,0]=3 132 B5R1.2 ClC1CCC1 T70092 [1,0,0,1,0,0|1,0,0]=3 133 B5R1.2 ClC1CNC1 37968 [1,0,0,1,0,0|2,0,0]=4 134 B5R1.2 ClC1COC1 CS1986 [1,0,0,1,0,0|1,1,0]=4 135 B5R1.2 FC1CNC1 SC2901 [1,0,0,1,0,0|2,0,0]=4 136 B5R1.2 IC1CCC1 P17114 [1,0,0,1,0,0|1,0,0]=3 137 B5R1.2 NC1CSC1 39038 [1,0,0,1,0,0|1,0,0]=3 138 B5R1.2 SC1CNC1 38596 [1,0,0,1,0,0|1,0,0]=3 139 B5R1.2 SC1COC1 32902 [1,0,0,1,0,0|0,1,0]=3 140 B5R1.3 ICC1CC1 P19124 [1,0,0,1,0,0|2,0,0]=4 141 B5R1.4 CC1CC1N 72192 [1,0,0,1,0,0|1,0,0]=3 142 B5R1.4 CC1CC1N 72742 [1,0,0,1,0,0|1,0,0]=3 143 B5R1.4 N[C@@H]1C[C@@H]1F D79320 [1,0,0,1,0,0|2,0,0]=4 144 B5R1.4 N[C@@H]1C[C@@H]1F P17919 [1,0,0,1,0,0|2,0,0]=4 145 B5R1.4 N[C@@H]1C[C@@H]1O C93526 [1,0,0,1,0,0|1,1,0]=4 146 B5R1.4 N[C@H]1C[C@@H]1F CS3399 [1,0,0,1,0,0|2,0,0]=4 147 B5R1.4 N[C@H]1C[C@@H]1N P18270 [1,0,0,1,0,0|2,0,0]=4 148 B5R1.5 CC1(C)CN1 56316 [1,0,0,1,0,0|2,0,0]=4 149 B5R1.5 CC1(O)CC1 83778 [1,0,0,1,0,0|0,1,0]=3 150 B7R1.2 C[C@@H]1C[C@H](O)CN1 F13013 [0,0,0,1,0,1|1,1,0]=4 151 B7R1.2 C[C@H]1CC[C@@H](C)N1 P17782 [0,0,0,1,0,1|2,0,0]=4 152 B7R1.2 C[C@H]1CC[C@H](C)N1 P19223 [0,0,0,1,0,1|2,0,0]=4 153 B7R1.2 NC1CCC(N)C1 D79385 [0,0,0,1,0,1|2,0,0]=4 154 B7R1.2 NC1CCC(O)C1 21055 [0,0,0,1,0,1|1,1,0]=4 155 B7R1.2 NC1CCC(O)C1 26425 [0,0,0,1,0,1|1,1,0]=4 156 B7R1.2 N[C@@H]1CC[C@H](F)C1 P18588 [0,0,0,1,0,1|2,0,0]=4 157 B7R1.2 N[C@@H]1CC[C@H](F)C1 P20484 [0,0,0,1,0,1|2,0,0]=4 158 B7R1.2 N[C@@H]1CC[C@H](O)C1 27526 [0,0,0,1,0,1|1,1,0]=4 159 B7R1.2 N[C@@H]1CC[C@H](O)C1 38967 [0,0,0,1,0,1|1,1,0]=4 160 B7R1.2 N[C@@H]1CC[C@H](O)C1 72087 [0,0,0,1,0,1|1,1,0]=4 161 B7R1.2 N[C@@H]1CC[C@H](O)C1 72088 [0,0,0,1,0,1|1,1,0]=4 162 B7R1.2 N[C@@H]1CC[C@H](O)C1 72349 [0,0,0,1,0,1|1,1,0]=4 163 B7R1.2 N[C@@H]1CC[C@H](O)C1 W11751 [0,0,0,1,0,1|1,1,0]=4 164 B7R1.2 N[C@H]1CC[C@H](N)C1 F53332 [0,0,0,1,0,1|2,0,0]=4 165 B7R1.2 N[C@H]1CC[C@H](O)C1 27518 [0,0,0,1,0,1|1,1,0]=4 166 B7R1.2 N[C@H]1CC[C@H](O)C1 31093 [0,0,0,1,0,1|1,1,0]=4 167 B7R1.2 N[C@H]1CC[C@H](O)C1 W11748 [0,0,0,1,0,1|1,1,0]=4 168 B7R1.2 O[C@H]1CC[C@@H](O)C1 P16667 [0,0,0,1,0,1|0,2,0]=4 169 B7R1.16 CC1(C)CC(N)C1 P15356 [0,0,0,1,0,1|2,0,0]=4 170 B7R1.16 CC1(C)CC(O)C1 P16551 [0,0,0,1,0,1|1,1,0]=4 171 B7R1.16 CC1(N)CC(F)C1 P18908 [0,0,0,1,0,1|2,0,0]=4 172 B7R1.16 CC1(N)CC(O)C1 38885 [0,0,0,1,0,1|1,1,0]=4 173 B7R1.16 C[C@]1(N)C[C@@H](O)C1 P13531 [0,0,0,1,0,1|1,1,0]=4 174 B7R1.16 C[C@]1(N)C[C@H](O)C1 38886 [0,0,0,1,0,1|1,1,0]=4 175 B7R1.16 C[C@]1(O)C[C@@H](N)C1 38620 [0,0,0,1,0,1|1,1,0]=4 176 B7R1.20 C[C@H](O)CC1CC1 79072 [0,0,0,1,0,1|1,1,0]=4 177 B7R1.4 Br[C@H]1CCC[C@@H]1Br D97021 [0,1,0,1,0,0|2,0,0]=4 178 B7R1.4 CC1CNCC1C P18713 [0,1,0,1,0,0|2,0,0]=4 179 B7R1.4 C[C@@H]1CCC[C@@H]1N 72991 [0,1,0,1,0,0|2,0,0]=4 180 B7R1.4 C[C@@H]1CCC[C@@H]1O 72407 [0,1,0,1,0,0|1,1,0]=4 181 B7R1.4 C[C@@H]1CNC[C@@H]1F 73104 [0,1,0,1,0,0|2,0,0]=4 182 B7R1.4 C[C@@H]1CNC[C@@H]1N F13008 [0,1,0,1,0,0|2,0,0]=4 183 B7R1.4 C[C@@H]1CNC[C@@H]1O 72981 [0,1,0,1,0,0|1,1,0]=4 184 B7R1.4 C[C@H]1CCC[C@@H]1O 71002 [0,1,0,1,0,0|1,1,0]=4 185 B7R1.4 C[C@H]1CNC[C@@H]1O 72668 [0,1,0,1,0,0|1,1,0]=4 186 B7R1.4 C[C@H]1COC[C@@H]1N P16382 [0,1,0,1,0,0|1,1,0]=4 187 B7R1.4 C[C@H]1COC[C@@H]1O 73077 [0,1,0,1,0,0|0,2,0]=4 188 B7R1.4 F[C@H]1CNC[C@H]1F 83249 [0,1,0,1,0,0|2,0,0]=4 189 B7R1.4 NC1CCCC1N F16273 [0,1,0,1,0,0|2,0,0]=4 190 B7R1.4 NC1COCC1O O11159 [0,1,0,1,0,0|1,1,0]=4 191 B7R1.4 N[C@@H]1CCC[C@@H]1O P10925 [0,1,0,1,0,0|1,1,0]=4 192 B7R1.4 N[C@@H]1COC[C@@H]1F W12424 [0,1,0,1,0,0|2,0,0]=4 193 B7R1.4 N[C@@H]1COC[C@@H]1N P15675 [0,1,0,1,0,0|2,0,0]=4 194 B7R1.4 N[C@@H]1COC[C@@H]1O F53671 [0,1,0,1,0,0|1,1,0]=4 195 B7R1.4 N[C@@H]1COC[C@@H]1O P12686 [0,1,0,1,0,0|1,1,0]=4 196 B7R1.4 N[C@H]1CCC[C@@H]1F P17786 [0,1,0,1,0,0|2,0,0]=4 197 B7R1.4 N[C@H]1CCC[C@@H]1N F16352 [0,1,0,1,0,0|2,0,0]=4 198 B7R1.4 N[C@H]1CCC[C@@H]1O 71753 [0,1,0,1,0,0|1,1,0]=4 199 B7R1.4 N[C@H]1CCC[C@H]1N I12005 [0,1,0,1,0,0|2,0,0]=4 200 B7R1.4 N[C@H]1CNC[C@@H]1F D72106 [0,1,0,1,0,0|2,0,0]=4 201 B7R1.4 N[C@H]1COC[C@@H]1F W12730 [0,1,0,1,0,0|2,0,0]=4 202 B7R1.4 N[C@H]1COC[C@@H]1N 37783 [0,1,0,1,0,0|2,0,0]=4 203 B7R1.4 N[C@H]1COC[C@@H]1N 37786 [0,1,0,1,0,0|2,0,0]=4 204 B7R1.4 N[C@H]1COC[C@@H]1N P15676 [0,1,0,1,0,0|2,0,0]=4 205 B7R1.4 N[C@H]1COC[C@@H]1O 71841 [0,1,0,1,0,0|1,1,0]=4 206 B7R1.4 N[C@H]1COC[C@@H]1O P12486 [0,1,0,1,0,0|1,1,0]=4 207 B7R1.4 N[C@H]1COC[C@@H]1O P15828 [0,1,0,1,0,0|1,1,0]=4 208 B7R1.4 O[C@@H]1CNC[C@@H]1F 72988 [0,1,0,1,0,0|1,1,0]=4 209 B7R1.4 O[C@H]1CNC[C@@H]1F 38827 [0,1,0,1,0,0|1,1,0]=4 210 B7R1.4 O[C@H]1CNC[C@@H]1F P15834 [0,1,0,1,0,0|1,1,0]=4 211 B7R1.4 O[C@H]1CNC[C@@H]1O 39002 [0,1,0,1,0,0|0,2,0]=4 212 B7R1.4 O[C@H]1CNC[C@@H]1O P15707 [0,1,0,1,0,0|0,2,0]=4 213 B7R1.4 O[C@H]1COC[C@@H]1F 73076 [0,1,0,1,0,0|1,1,0]=4 214 B7R1.4 O[C@H]1COC[C@@H]1O 66690 [0,1,0,1,0,0|0,2,0]=4 215 B7R1.8 CC1NCC1C#N D96740 [0,1,0,1,0,0|2,0,0]=4 216 B7R1.17 CC1(C)CC[C@@H]1N AT10475 [0,1,0,1,0,0|2,0,0]=4 217 B7R1.17 C[C@@H]1NCC1(F)F D79133 [0,1,0,1,0,0|2,0,0]=4 218 B7R1.17 C[C@@H]1NCC1(F)F P20356 [0,1,0,1,0,0|2,0,0]=4 219 B7R1.18 CC(C)C1CNC1 D79219 [0,1,0,1,0,0|2,0,0]=4 220 B7R1.18 C[C@H](N)C1CCC1 93060 [0,1,0,1,0,0|2,0,0]=4 221 B7R1.18 C[C@H](N)C1CCC1 93062 [0,1,0,1,0,0|2,0,0]=4 222 B7R1.18 C[C@H](O)C1COC1 P18451 [0,1,0,1,0,0|0,2,0]=4 223 B7R1.19 CC(C)C1(O)CC1 P17163 [0,1,0,1,0,0|1,1,0]=4 224 B7R1.22 N[C@@H](CO)C1CC1 N11217 [0,1,0,1,0,0|2,0,0]=4 225 B7R1.22 N[C@@H](CO)C1CC1 P18914 [0,1,0,1,0,0|2,0,0]=4 226 B7R1.22 N[C@@H](CO)C1CC1 Y14567 [0,1,0,1,0,0|2,0,0]=4 227 B7R1.26 CC(C)(N)C1CC1 72848 [0,1,0,1,0,0|2,0,0]=4 228 B7R1.26 CC(C)(O)C1CC1 78550 [0,1,0,1,0,0|1,1,0]=4 229 B7R0.6 C[C@H](O)CC[C@H](C)O F17009 [0,0,0,0,0,2|0,2,0]=4